prop-2-enyl 2-(hydroxymethyl)-5-(triphenylmethyl)sulfanyl-piperidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-(hydroxymethyl)-5-(triphenylmethyl)sulfanyl-piperidine-1-carboxylate Openeye Name: allyl 2-(hydroxymethyl)-5-tritylsulfanyl-piperidine-1-carboxylate CAS Name: 2-(hydroxymethyl)-5-[(triphenylmethyl)thio]-1-piperidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-(hydroxymethyl)-5-tritylsulfanylpiperidine-1-carboxylate Traditional Name: 2-methylol-5-(tritylthio)piperidine-1-carboxylic acid allyl ester Formula: C29H31NO3S MolecularWeight: 473.62634

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(CCC1CO)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C=CCOC(=O)N1CC(CCC1CO)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H31NO3S/c1-2-20-33-28(32)30-21-27(19-18-26(30)22-31)34-29(23-12-6-3-7-13-23,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h2-17,26-27,31H,1,18-22H2